2,5-dichloro-N-(2-pyridin-2-ylethyl)thiophene-3-sulfonamide

C11H10Cl2N2O2S2 — CID 4657628

IUPAC2,5-dichloro-N-(2-pyridin-2-ylethyl)thiophene-3-sulfonamide
SMILESO=S(=O)(NCCc1ccccn1)c1cc(Cl)sc1Cl
InChIInChI=1S/C11H10Cl2N2O2S2/c12-10-7-9(11(13)18-10)19(16,17)15-6-4-8-3-1-2-5-14-8/h1-3,5,7,15H,4,6H2
InChIKeyZWYOSMISOCOHGK-UHFFFAOYSA-N
MW337.25 g/mol
LogP2.97
Rot. Bonds5

About 2,5-dichloro-N-(2-pyridin-2-ylethyl)thiophene-3-sulfonamide

2,5-dichloro-N-(2-pyridin-2-ylethyl)thiophene-3-sulfonamide (PubChem CID 4657628) has the molecular formula C11H10Cl2N2O2S2 and a molecular weight of 337.25 g/mol. Its IUPAC name is 2,5-dichloro-N-(2-pyridin-2-ylethyl)thiophene-3-sulfonamide.

Molecular Properties

Compound Name2,5-dichloro-N-(2-pyridin-2-ylethyl)thiophene-3-sulfonamide
PubChem CID4657628
Molecular FormulaC11H10Cl2N2O2S2
Molecular Weight337.25 g/mol
Exact Mass335.96
IUPAC Name2,5-dichloro-N-(2-pyridin-2-ylethyl)thiophene-3-sulfonamide
SMILESO=S(=O)(NCCc1ccccn1)c1cc(Cl)sc1Cl
InChIInChI=1S/C11H10Cl2N2O2S2/c12-10-7-9(11(13)18-10)19(16,17)15-6-4-8-3-1-2-5-14-8/h1-3,5,7,15H,4,6H2
InChIKeyZWYOSMISOCOHGK-UHFFFAOYSA-N
XLogP2.97
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.25
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-dichloro-N-(2-pyridin-2-ylethyl)benzenesulfonamide
CID 47104213
2-chloro-4-methyl-N-(2-pyridin-2-ylethyl)benzenesulfonamide
CID 32673521
3,5-dichloro-N-(2-pyridin-2-ylethyl)benzenesulfonamide
CID 3799880
2-hydroxy-N-(2-pyridin-2-ylethyl)benzenesulfonamide
CID 81241460
4-[(2,5-dichlorothiophen-3-yl)sulfonylamino]-N-(pyridin-2-ylmethyl)benzamide
CID 2475991
2-cyano-N-(2-pyridin-2-ylethyl)benzenesulfonamide
CID 24710652
4-bromo-2-fluoro-N-(2-pyridin-2-ylethyl)benzenesulfonamide
CID 116528063
4-chloro-3-nitro-N-(2-pyridin-2-ylethyl)benzenesulfonamide
CID 4878966
6-amino-5-chloro-N-(2-pyridin-2-ylethyl)pyridine-3-sulfonamide
CID 64607542
5-chloro-6-oxo-N-(2-pyridin-2-ylethyl)-1H-pyridine-3-sulfonamide
CID 64609007
N-benzyl-2,5-dichlorothiophene-3-sulfonamide
CID 39791947
2,5-dichloro-N-[2-(4-sulfamoylphenyl)ethyl]thiophene-3-sulfonamide
CID 39792284

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-(2-pyridin-2-ylethyl)thiophene-3-sulfonamide?
The IUPAC name of 2,5-dichloro-N-(2-pyridin-2-ylethyl)thiophene-3-sulfonamide (CID 4657628) is 2,5-dichloro-N-(2-pyridin-2-ylethyl)thiophene-3-sulfonamide.
What is the SMILES notation for 2,5-dichloro-N-(2-pyridin-2-ylethyl)thiophene-3-sulfonamide?
The canonical SMILES for 2,5-dichloro-N-(2-pyridin-2-ylethyl)thiophene-3-sulfonamide is O=S(=O)(NCCc1ccccn1)c1cc(Cl)sc1Cl.
What is the InChIKey of 2,5-dichloro-N-(2-pyridin-2-ylethyl)thiophene-3-sulfonamide?
The InChIKey is ZWYOSMISOCOHGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10Cl2N2O2S2/c12-10-7-9(11(13)18-10)19(16,17)15-6-4-8-3-1-2-5-14-8/h1-3,5,7,15H,4,6H2.
What are the key properties of 2,5-dichloro-N-(2-pyridin-2-ylethyl)thiophene-3-sulfonamide?
2,5-dichloro-N-(2-pyridin-2-ylethyl)thiophene-3-sulfonamide has a molecular weight of 337.25 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-(2-pyridin-2-ylethyl)thiophene-3-sulfonamide is sourced from PubChem (CID 4657628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).